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330792-76-2 | 2-Phenoxy-5-(4,4,5,5-tetramethyl-[1,3,2] dioxaborolan-2-yl)-pyridine
CAS No: 330792-76-2 Catalog No: AG00CIRD MDL No:MFCD11878216
Product Description
Catalog Number:
AG00CIRD
Chemical Name:
2-Phenoxy-5-(4,4,5,5-tetramethyl-[1,3,2]
dioxaborolan-2-yl)-pyridine
CAS Number:
330792-76-2
Molecular Formula:
C17H20BNO3
Molecular Weight:
297.1566
MDL Number:
MFCD11878216
IUPAC Name:
2-phenoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine
InChI:
InChI=1S/C17H20BNO3/c1-16(2)17(3,4)22-18(21-16)13-10-11-15(19-12-13)20-14-8-6-5-7-9-14/h5-12H,1-4H3
InChI Key:
GMABRSOCDYXLIF-UHFFFAOYSA-N
SMILES:
CC1(C)OB(OC1(C)C)c1ccc(nc1)Oc1ccccc1
Properties
Complexity:
366
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
297.154g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
297.161g/mol
Monoisotopic Mass:
297.154g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
40.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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